Synthesis, spectroscopic characterization, reactive properties by DFT calculations, molecular dynamics simulations and biological evaluation of Schiff bases tethered 1, 2, 4 … RR Pillai, K Karrouchi, S Fettach, S Armaković, SJ Armaković, Y Brik, ... Journal of Molecular Structure 1177, 47-54, 2019 | 90 | 2019 |
Synthesis, XRD crystal structure, spectroscopic characterization (FT-IR, 1H and 13C NMR), DFT studies, chemical reactivity and bond dissociation energy studies using molecular … DA Zainuri, S Arshad, NC Khalib, IA Razak, RR Pillai, SF Sulaiman, ... Journal of Molecular Structure 1128, 520-533, 2017 | 65 | 2017 |
Spectroscopic (FT-IR, FT-Raman) investigations and quantum chemical calculations of 1, 7, 8, 9-tetrachloro-10, 10-dimethoxy-4-{3-[4-(3-methoxyphenyl) piperazin-1-yl] propyl}-4 … R Renjith, YS Mary, CY Panicker, HT Varghese, M Pakosińska-Parys, ... Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 129, 438-450, 2014 | 29 | 2014 |
Synthesis, molecular modeling, quantum mechanical calculations and ADME estimation studies of benzimidazole-oxadiazole derivatives as potent antifungal agents UA Çevik, I Celik, A Işık, RR Pillai, TE Tallei, R Yadav, Y Özkay, ... Journal of Molecular Structure 1252, 132095, 2022 | 27 | 2022 |
Vibrational spectroscopic investigations, molecular dynamic simulations and molecular docking studies of N′-diphenylmethylidene-5-methyl-1H-pyrazole-3-carbohydrazide RR Pillai, VV Menon, YS Mary, S Armaković, SJ Armaković, CY Panicker Journal of Molecular Structure 1130, 208-222, 2017 | 27 | 2017 |
Spectroscopic (FT-IR, FT-Raman), first order hyperpolarizability, NBO analysis, HOMO and LUMO analysis of 1, 7, 8, 9-tetrachloro-10, 10-dimethoxy-4-[3-(4-phenylpiperazin-1-yl … R Renjith, YS Mary, CY Panicker, HT Varghese, M Pakosińska-Parys, ... Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 124, 500-513, 2014 | 27 | 2014 |
Spectroscopic investigation (FT-IR and FT-Raman), vibrational assignments, HOMO–LUMO analysis and molecular docking study of 1-hydroxy-4, 5, 8-tris (4-methoxyphenyl) anthraquinone R Renjith, YS Mary, HT Varghese, CY Panicker, T Thiemann, A Shereef, ... Journal of Physics and Chemistry of Solids 87, 110-121, 2015 | 25 | 2015 |
Remarkable colorimetric sensing behavior of pyrazole-based chemosensor towards Cu (ii) ion detection: synthesis, characterization and theoretical investigations N Nayak, KS Prasad, RR Pillai, S Armaković, SJ Armaković RSC advances 8 (32), 18023-18029, 2018 | 23 | 2018 |
Tumoricidal potential of novel Amino-1, 10-phenanthroline derived imine ligands: chemical preparation, structure, and biological investigations KS Prasad, RR Pillai, C Shivamallu, SK Prasad, AS Jain, S Pradeep, ... Molecules 25 (12), 2865, 2020 | 20 | 2020 |
Indole moiety induced biological potency in pseudo-peptides derived from 2-amino-2-(1H-indole-2-yl) based acetamides: Chemical synthesis, in vitro anticancer activity and … KS Prasad, RR Pillai, MP Ghimire, R Ray, M Richter, C Shivamallu, ... Journal of Molecular Structure 1217, 128445, 2020 | 17 | 2020 |
Photophysical properties and theoretical investigations of newly synthesized pyrene-naphthalene based Schiff base ligand and its copper (II) complexes KS Prasad, RR Pillai, S Armaković, SJ Armaković Inorganica Chimica Acta 486, 698-703, 2019 | 16 | 2019 |
Synthesis and investigations of reactive properties, photophysical properties and biological activities of a pyrazole-triazole hybrid molecule K Karrouchi, I Celik, S Fettach, T Karthick, K Bougrin, S Radi, MEA Faouzi, ... Journal of Molecular Structure 1265, 133363, 2022 | 14 | 2022 |
Adsorption properties of graphene towards the ephedrine–A frequently used molecule in sport S Armaković, SJ Armaković, BT Tomić, RR Pillai, CY Panicker Computational and Theoretical Chemistry 1124, 39-50, 2018 | 14 | 2018 |
Synthesis, XRD crystal structure, spectroscopic characterization, local reactive properties using DFT and molecular dynamics simulations and molecular docking study of (E)-1-(4 … S Arshad, RR Pillai, DA Zainuri, NC Khalib, IA Razak, S Armaković, ... Journal of Molecular Structure 1137, 419-430, 2017 | 14 | 2017 |
Vibrational spectra, molecular structure, NBO, HOMO–LUMO and first order hyperpoalarizability analysis of 1, 4-bis (4-formylphenyl) anthraquinone by density functional theory R Renjith, YS Mary, HT Varghese, CY Panicker, T Thiemann, ... Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 131, 225-234, 2014 | 13 | 2014 |
Vibrational spectroscopic and computational study of 1, 7, 8, 9-Tetrachloro-4-(4-bromo-butyl)-10, 10-dimethoxy-4-aza-tricyclo [5.2. 1.02, 6] dec-8-ene-3, 5-dione R Renjith, YS Mary, CY Panicker, HT Varghese, M Pakosińska-Parys, ... Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 124, 480-491, 2014 | 12 | 2014 |
Synthesis, theoretical studies and molecular docking of a novel chlorinated tetracyclic:(Z/E)-3-(1, 8-dichloro-9, 10-dihydro-9, 10-ethanoanthracen-11-yl) acrylaldehyde MA Sultan, AI Almansour, RR Pillai, RS Kumar, N Arumugam, ... Journal of Molecular Structure 1150, 358-365, 2017 | 8 | 2017 |
Theoretical investigation on the reactivity and photophysical properties of cobalt (II) and manganese (II) complexes constructed using Schiff base ligands based on ALIE and … KS Prasad, RR Pillai, S Armaković, SJ Armaković Polyhedron 129, 141-148, 2017 | 8 | 2017 |
Exploring the structural, photophysical and optoelectronic properties of a diaryl heptanoid curcumin derivative and identification as a SARS-CoV-2 inhibitor VP Archana, SJ Armaković, S Armaković, I Celik, JB Bhagyasree, ... Journal of Molecular Structure 1281, 135110, 2023 | 7 | 2023 |
S. Armakovi c, SJ Armakovi c, Y. Brik, J. Taoufik, S RR Pillai, K Karrouchi, S Fettach Radi, MEA Faouzi, MH Ansar, Synthesis, spectroscopic charac-terization …, 0 | 7 | |